Code

Class_format#17

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benshi97 merged 35 commits intoskzcambenshi97/quacc:skzcamfrom class_formatbenshi97/quacc:class_formatCopy head branch name to clipboardJul 25, 2024

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Commits

Commits on Jun 9, 2024

• Class for MRCC inputs

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• Make a class for generating orca inputs

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• Class for CreateSKZCAMClusters

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• Better variable definitions

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• Clean up docstrings

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• Fix conftest

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• Fix docs

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• Merge branch 'class_format' of github.com:benshi97/quacc into class_format

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• small cleanup

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• Remove stray comment

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Commits on Jun 10, 2024

• Fix docstring

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• Order functions better

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• Merge branch 'class_format' of github.com:benshi97/quacc into class_format

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• Update conftest.py

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Commits on Jun 11, 2024

• Fix unit tests

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• Add attribute descriptions.

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• Merge branch 'class_format' of github.com:benshi97/quacc into class_format

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Commits on Jun 20, 2024

• Merge branch 'skzcam' into class_format

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Commits on Jun 29, 2024

• Merge branch 'main' into class_format

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• Revert "Merge branch 'main' into class_format"

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• Update test_mrcc.py

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Commits on Jul 1, 2024

• Merge branch 'skzcam' into class_format

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• Fix hinting

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